3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine

C9H11N5 — CID 102988564

IUPAC3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine
SMILESCc1ncn(-c2nccnc2N)c1C
InChIInChI=1S/C9H11N5/c1-6-7(2)14(5-13-6)9-8(10)11-3-4-12-9/h3-5H,1-2H3,(H2,10,11)
InChIKeyKKFHEASDXPMJRT-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.86
Rot. Bonds1

About 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine

3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine (PubChem CID 102988564) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine
PubChem CID102988564
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC Name3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine
SMILESCc1ncn(-c2nccnc2N)c1C
InChIInChI=1S/C9H11N5/c1-6-7(2)14(5-13-6)9-8(10)11-3-4-12-9/h3-5H,1-2H3,(H2,10,11)
InChIKeyKKFHEASDXPMJRT-UHFFFAOYSA-N
XLogP0.86
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine?
The IUPAC name of 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine (CID 102988564) is 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine.
What is the SMILES notation for 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine?
The canonical SMILES for 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine is Cc1ncn(-c2nccnc2N)c1C.
What is the InChIKey of 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine?
The InChIKey is KKFHEASDXPMJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c1-6-7(2)14(5-13-6)9-8(10)11-3-4-12-9/h3-5H,1-2H3,(H2,10,11).
What are the key properties of 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine?
3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine has a molecular weight of 189.22 g/mol, XLogP of 0.86, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-dimethylimidazol-1-yl)pyrazin-2-amine is sourced from PubChem (CID 102988564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).